AIDS-133999

Molecular Formula: C₅₁H₈₈N₁₂O₁₄

InChI: InChI=1/C51H88N12O14/c1-8-28(4)39(54)48(73)63-41(30(6)10-3)50(75)61-36(25-64)45(70)55-31(7)42(67)59-38(27-66)47(72)62-40(29(5)9-2)49(74)57-34(21-15-17-23-53)43(68)56-33(20-14-16-22-52)44(69)60-37(26-65)46(71)58-35(51(76)77)24-32-18-12-11-13-19-32/h11-13,18-19,28-31,33-41,64-66H,8-10,14-17,20-27,52-54H2,1-7H3,(H,55,70)(H,56,68)(H,57,74)(H,58,71)(H,59,67)(H,60,69)(H,61,75)(H,62,72)(H,63,73)(H,76,77)/f/h55-63,76H

InChIKey: InChIKey=KMGOMSCWOODMFD-GASOIVPDCP
SMILES: CCC(C)C(C(=O)NC(C(C)CC)C(=O)NC(CO)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)NC(CC1=CC=CC=C1)C(=O)O)N

Names:
    AIDS-133999
    AIDS133999
    NSC631163
    2-[[2-[[6-amino-2-[[6-amino-2-[[2-[[2-[2-[[2-[[2-[(2-amino-3-methyl-pentanoyl)amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-methyl-pentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-hydroxy-propanoyl]amino]-3-phenyl-propanoic acid
    29-Amino-8,11-bis(4-aminobutyl)-2-benzyl-14,26-disec-butyl-5,17,23-tris(hydroxymethyl)-20,30-dimethyl-4,7,10,13,16,19,22,25,28-nonaoxo-3,6,9,12,15,18,21,24,27-nonaazadotriacontan-1-oic acid

Registries:
    PubChem CID 364629
    PubChem ID 229948